2-[2,5-bis(oxidanylidene)pyrrol-1-yl]octanoic acid

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]octanoic acid Openeye Name: 2-(2,5-dioxopyrrol-1-yl)octanoic acid CAS Name: 2-(2,5-dioxo-1-pyrrolyl)octanoic acid IUPAC Name: 2-(2,5-dioxopyrrol-1-yl)octanoic acid Traditional Name: 2-maleimidocaprylic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)N1C(=O)C=CC1=O

Isomeric SMILES

CCCCCCC(C(=O)O)N1C(=O)C=CC1=O

InChI

InChI=1S/C12H17NO4/c1-2-3-4-5-6-9(12(16)17)13-10(14)7-8-11(13)15/h7-9H,2-6H2,1H3,(H,16,17)